Prediction of the Relative Free Energies of Drug Polymorphs above Zero Kelvin-Reference-Cited by-同舟云学术

Prediction of the Relative Free Energies of Drug Polymorphs above Zero Kelvin

Published:2020-07-01 Issue:8 Volume:20 Page:5211-5224
ISSN:1528-7483
Container-title:Crystal Growth & Design
language:en
Short-container-title:Crystal Growth & Design

Author:

Yang Mingjun¹^ORCID,Dybeck Eric²,Sun Guangxu¹,Peng Chunwang¹,Samas Brian²,Burger Virginia M.³,Zeng Qun¹,Jin Yingdi¹,Bellucci Michael A.³^ORCID,Liu Yang¹,Zhang Peiyu¹,Ma Jian¹,Jiang Yide Alan³,Hancock Bruno C.²^ORCID,Wen Shuhao³⁴,Wood Geoffrey P. F.²^ORCID

Affiliation:

1. XtalPi Inc. (Shenzhen Jingtai Technology Co., Ltd.), Floor 4, No. 9, Hualian Industrial Zone, Dalang Street, Longhua District, Shenzhen, 518100, China

2. Pfizer Worldwide R&D, Groton, Connecticut 06340, United States

3. XtalPi Inc., 245 Main St, 12th Floor, Cambridge, Massachusetts 02142, United States

4. Shenzhen Jingtai Technology Co., Ltd., Floor 4, No. 9, Hualian Industrial Zone, Dalang Street, Longhua District, Shenzhen, 518100, China

Funder

XtalPi Inc

Publisher

American Chemical Society (ACS)

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.cgd.0c00422

Reference81 articles.

1. Crystallisation within transdermal rotigotine patch: is there cause for concern?

2. Report on the sixth blind test of organic crystal structure prediction methods

3. Towards crystal structure prediction of complex organic compounds – a report on the fifth blind test

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